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Feature: add OpenMP in XC_Functional_Libxc::v_xc_libxc() (#7130) Container #298: Commit d0a094b pushed by AsTonyshment
1s develop
develop
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Refactor onsite_proj COMPONENTS and add dspin examples (#7211) Container #297: Commit f27e198 pushed by AsTonyshment
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fix compilation warning (#7215) Container #296: Commit 78bfe12 pushed by AsTonyshment
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feat(gint): enable mixed-precision (fp32/fp64) support for GPU path (… Container #295: Commit 3a996b6 pushed by AsTonyshment
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Update version to v3.9.0.27 (#7206) Container #294: Commit e98b1e4 pushed by AsTonyshment
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Fix the issue of inconsistent behavior between estep and md_nstep. (#… Container #293: Commit bf92c2d pushed by AsTonyshment
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Add initialization checking in BFGS, and replace the old BFGS with a … Container #292: Commit abf77eb pushed by AsTonyshment
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Fix IntArray class and a few math classes with memory management and … Container #291: Commit 16cd841 pushed by AsTonyshment
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develop
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Fix: add runtime check for cudaHostRegister in EXX PW (#7157) Container #290: Commit e3eee6f pushed by AsTonyshment
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Feature: support the setting on atomic magnetic moment via ase.atoms.… Container #289: Commit e97cf59 pushed by AsTonyshment
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Fix threshold. (#7118) Container #288: Commit 27bff48 pushed by AsTonyshment
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Refactor: split timer::tick() to timer::start() and `timer::end()… Container #287: Commit 370e67c pushed by AsTonyshment
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Update version to v3.9.0.26 (#7070) Container #286: Commit d1b4fc2 pushed by AsTonyshment
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2026PKUCourseHW5: Fix C-style cast in source/source_cell/module_symme… Container #285: Commit db8a9dd pushed by AsTonyshment
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修复了input.cpp char数组溢出风险 (#7050) Container #284: Commit 7d641c1 pushed by AsTonyshment
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add output-specification in doc (#7031) Container #283: Commit cc50db0 pushed by AsTonyshment
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Let's try removing the template of ESolver_KS_pw again (#7028) Container #282: Commit 342de19 pushed by AsTonyshment
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Container Container #281: by AsTonyshment
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Refactor device parameter in esolver_ks_pw (#7016) Container #280: Commit a10e537 pushed by AsTonyshment
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Try removing template dependency of ESolver (#7014) Container #279: Commit 8a09b8a pushed by AsTonyshment
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Esolver refactor for LCAO and pw (#7012) Container #278: Commit 58cc834 pushed by AsTonyshment
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Refactor: remove dependence of Tensor for cg interface (#7000) Container #277: Commit 51e2a78 pushed by AsTonyshment
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Refactor: Optimize memory management in RT-TDDFT to enable large-scal… Container #276: Commit 7035e85 pushed by AsTonyshment
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Container Container #275: by AsTonyshment
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Fix: correct the unit conversion between Plumed and ASE in example (#… Container #274: Commit d999af7 pushed by AsTonyshment
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